N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.4200 | 0.1100 | 0.0400 | 0.0000 | Ni |
2 | 0.7250 | 0.1850 | 0.4900 | 0.0000 | S |
3 | 0.6900 | 0.0800 | 0.3700 | 0.0000 | O |
4 | 0.8600 | 0.1900 | 0.4800 | 0.0000 | O |
5 | 0.6900 | 0.1900 | 0.6900 | 0.0000 | O |
6 | 0.6800 | 0.2800 | 0.3700 | 0.0000 | O |
7 | 0.2600 | 0.1700 | 0.0100 | 0.0000 | H2O |
8 | 0.4600 | 0.2500 | 0.1900 | 0.0000 | H2O |
9 | 0.4600 | 0.1800 | 0.7900 | 0.0000 | H2O |
10 | 0.5700 | 0.0400 | 0.0500 | 0.0000 | H2O |
11 | 0.3600 | 0.9600 | 0.9100 | 0.0000 | H2O |
12 | 0.3600 | 0.0300 | 0.2900 | 0.0000 | H2O |
13 | 0.4800 | 0.4400 | 0.9300 | 0.0000 | H2O |